3-[3,4-bis(fluoranyl)phenyl]-1-[2-[4-(4-fluorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxidanylidene-ethyl]-1-propan-2-yl-urea

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]-1-[2-[4-(4-fluorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxidanylidene-ethyl]-1-propan-2-yl-urea Openeye Name: 3-(3,4-difluorophenyl)-1-[2-[4-(4-fluorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxo-ethyl]-1-isopropyl-urea CAS Name: 3-(3,4-difluorophenyl)-1-[2-[4-(4-fluorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-1-propan-2-ylurea IUPAC Name: 3-(3,4-difluorophenyl)-1-[2-[4-(4-fluorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-1-propan-2-ylurea Traditional Name: 3-(3,4-difluorophenyl)-1-[2-[4-(4-fluorophenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-keto-ethyl]-1-isopropyl-urea Formula: C29H25F3N4O2 MolecularWeight: 518.52961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)F)C(=O)NC5=CC(=C(C=C5)F)F

Isomeric SMILES

CC(C)N(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)F)C(=O)NC5=CC(=C(C=C5)F)F

InChI

InChI=1S/C29H25F3N4O2/c1-18(2)35(29(38)33-21-13-14-22(31)23(32)16-21)17-27(37)36-25-7-4-3-6-24(25)34-15-5-8-26(34)28(36)19-9-11-20(30)12-10-19/h3-16,18,28H,17H2,1-2H3,(H,33,38)